PUBCHEM-ZINC05764804 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 1.6920 -1.9600 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -3.1810 0.9680 N 0 3 3 0 0 0 0 0 0 0 0 0 1.3230 -4.2560 1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -5.6080 1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -5.9100 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -4.7290 -0.9110 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4280 -4.9380 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -3.4650 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -4.5120 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -3.9700 0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4260 -4.7830 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.8910 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -3.3920 -0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -4.2110 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -5.3680 0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 -3.6880 -0.6230 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7600 -4.8260 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2030 -4.8370 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9850 -5.8820 -2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3240 -6.9160 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8800 -6.9060 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 -5.8630 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5670 -3.0530 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 -1.8500 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6840 -1.4760 1.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5490 -2.3750 2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 -3.7890 2.1660 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 -2.7140 -1.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -2.1300 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -1.1300 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -1.7200 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -4.3190 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -4.0130 2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -6.3840 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -5.6760 1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -6.1240 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -6.7950 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -2.6270 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -3.6180 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -3.8100 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -5.4630 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 -2.7360 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -1.9440 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 -4.0290 -3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3320 -5.8900 -3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9350 -7.7310 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 -7.7130 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7450 -5.8570 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1820 -1.2150 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1790 -0.5270 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9080 -2.2550 3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -3.0530 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 2 1 M END